CID 22727108

4-chloro-n-methylpyridin-2-amine

Structural Information

Molecular Formula
C6H7ClN2
SMILES
CNC1=NC=CC(=C1)Cl
InChI
InChI=1S/C6H7ClN2/c1-8-6-4-5(7)2-3-9-6/h2-4H,1H3,(H,8,9)
InChIKey
KCMQNXMUEQVQBM-UHFFFAOYSA-N
Compound name
4-chloro-N-methylpyridin-2-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

40
Patents

142.02977 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 143.03705 124.2
[M+Na]+ 165.01899 138.5
[M+NH4]+ 160.06359 133.9
[M+K]+ 180.99293 131.1
[M-H]- 141.02249 127.2
[M+Na-2H]- 163.00444 133.0
[M]+ 142.02922 127.4
[M]- 142.03032 127.4
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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